6-[4-(diethylamino)phenyl]-5-ethanoyl-9-(furan-2-yl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one

Systemtic Name: 6-[4-(diethylamino)phenyl]-5-ethanoyl-9-(furan-2-yl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Openeye Name: 5-acetyl-6-[4-(diethylamino)phenyl]-9-(2-furyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one CAS Name: 5-acetyl-6-[4-(diethylamino)phenyl]-9-(2-furanyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one IUPAC Name: 5-acetyl-6-[4-(diethylamino)phenyl]-9-(furan-2-yl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Traditional Name: 5-acetyl-6-[4-(diethylamino)phenyl]-9-(2-furyl)-8,9,10,11-tetrahydro-6H-benzo[b][1,4]benzodiazepin-7-one Formula: C29H31N3O3 MolecularWeight: 469.57474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CO4)NC5=CC=CC=C5N2C(=O)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CO4)NC5=CC=CC=C5N2C(=O)C

InChI

InChI=1S/C29H31N3O3/c1-4-31(5-2)22-14-12-20(13-15-22)29-28-24(17-21(18-26(28)34)27-11-8-16-35-27)30-23-9-6-7-10-25(23)32(29)19(3)33/h6-16,21,29-30H,4-5,17-18H2,1-3H3